Information card for entry 7003467

Structure parameters

• Formula: C14 H18 Cu3 N12 O6 S4
• Calculated formula: C14 H16 Cu3 N12 O6 S4
• Title of publication: Low-dimensional copper(ii) complexes triply bridged with azide/carboxylate/DMSO showing very strong ferromagnetic interaction and influence of dipolar fields at low temperatures: a quantum Monte Carlo magnetic study
• Authors of publication: Tangoulis, V.; Panagoulis, D.; Raptopoulou, C. P.; Dendrinou-Samara, C.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 13
• Pages of publication: 1752 - 1760
• a: 8.331 ± 0.005 Å
• b: 10.657 ± 0.006 Å
• c: 9.147 ± 0.005 Å
• α: 103.69 ± 0.02°
• β: 115.89 ± 0.03°
• γ: 98.88 ± 0.02°
• Cell volume: 678.3 ± 0.7 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0666
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for significantly intense reflections: 0.1835
• Weighted residual factors for all reflections included in the refinement: 0.1855
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No